SCHEMBL4969251

SCHEMBL4969251

O=P(O)(O)OP(=O)(O)OP(=O)(O)On1cnc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.43
GGPS1 O95749 1/20 0.43
P2RY2 P41231 1/20 0.39
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.35
HTT P42858 1/20 0.35
FGFR1 P11362 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
STAT6 P42226 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25420047 0.82 FDPS (0.46) FDPSGGPS1ALOX15HSD17B10TDP1
SCHEMBL7068657 0.77 FDPS (0.43) FDPSGGPS1ALOX15HSD17B10TDP1
SCHEMBL595230 0.73 FDPS (0.46) FDPSP2RY2HSD17B10CYP1A2CYP3A4
SCHEMBL27554271 0.71 FDPS (0.47) FDPSP2RY2HSD17B10KMT2ALMNA
SCHEMBL8343857 0.71 HDAC6 (0.38) HSD17B10KDM4E
SCHEMBL1293053 0.69 TDP1 (0.52) ALOX15HSD17B10TDP1HTTFGFR1
SCHEMBL8901472 0.68 EGLN3 (0.46) ALOX15HSD17B10TDP1EGLN3HTT
SCHEMBL6392854 0.68 EGLN3 (0.46) ALOX15HSD17B10TDP1EGLN3HTT
SCHEMBL9378132 0.67 EGLN3 (0.49) ALOX15HSD17B10TDP1EGLN3HTT
SCHEMBL5613666 0.67 RPS6KA5 (0.45)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1777300-B1 Organic salt additives for nucleic acid amplification ROCHE DIAGNOSTICS GMBH (DE) 2008-08-27 EP disclosed